(1R,2S)-2-[(1-ethynylcyclohexyl)carbamoyl]cyclopropane-1-carboxylate

Systemtic Name: (1R,2S)-2-[(1-ethynylcyclohexyl)carbamoyl]cyclopropane-1-carboxylate Openeye Name: (1R,2S)-2-[(1-ethynylcyclohexyl)carbamoyl]cyclopropanecarboxylate CAS Name: (1R,2S)-2-[[(1-ethynylcyclohexyl)amino]-oxomethyl]-1-cyclopropanecarboxylate IUPAC Name: (1R,2S)-2-[(1-ethynylcyclohexyl)carbamoyl]cyclopropane-1-carboxylate Traditional Name: (1R,2S)-2-[(1-ethynylcyclohexyl)carbamoyl]cyclopropanecarboxylate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)NC(=O)C2CC2C(=O)[O-]

Isomeric SMILES

C#CC1(CCCCC1)NC(=O)[C@H]2C[C@H]2C(=O)[O-]

InChI

InChI=1S/C13H17NO3/c1-2-13(6-4-3-5-7-13)14-11(15)9-8-10(9)12(16)17/h1,9-10H,3-8H2,(H,14,15)(H,16,17)/p-1/t9-,10+/m0/s1